3-[[3-[2-(4-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamoyl]oxirane-2-carboxylic acid

Systemtic Name: 3-[[3-[2-(4-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamoyl]oxirane-2-carboxylic acid Openeye Name: 3-[[3-[2-(4-chlorophenyl)piperazin-1-yl]-3-oxo-propyl]carbamoyl]oxirane-2-carboxylic acid CAS Name: 3-[[[3-[2-(4-chlorophenyl)-1-piperazinyl]-3-oxopropyl]amino]-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: 3-[[3-[2-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl]carbamoyl]oxirane-2-carboxylic acid Traditional Name: 3-[[3-[2-(4-chlorophenyl)piperazino]-3-keto-propyl]carbamoyl]oxirane-2-carboxylic acid Formula: C17H20ClN3O5 MolecularWeight: 381.8108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C2=CC=C(C=C2)Cl)C(=O)CCNC(=O)C3C(O3)C(=O)O

Isomeric SMILES

C1CN(C(CN1)C2=CC=C(C=C2)Cl)C(=O)CCNC(=O)C3C(O3)C(=O)O

InChI

InChI=1S/C17H20ClN3O5/c18-11-3-1-10(2-4-11)12-9-19-7-8-21(12)13(22)5-6-20-16(23)14-15(26-14)17(24)25/h1-4,12,14-15,19H,5-9H2,(H,20,23)(H,24,25)